Structure Information
Structure

Compound Identification

SMILES

O=C(CNC(=O)C1=CC=CO1)NC1=CN(CC2=CC=CC(=C2)C#N)N=C1

InChIKey

InChIKey=SYQVTAWZHAIQDH-UHFFFAOYSA-N

Formula

C18H15N5O3

Mass

349.35

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Subclass

Amino acids, peptides, and analogues

Intermediate Tree Nodes

Amino acids and derivatives - Alpha amino acids and derivatives

Direct Parent

N-acyl-alpha amino acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - 2-heteroaryl carboxamide - Furoic acid or derivatives - Benzonitrile - N-arylamide - Monocyclic benzene moiety - Benzenoid - Azole - Furan - Heteroaromatic compound - Pyrazole - Carboxamide group - Secondary carboxylic acid amide - Oxacycle - Nitrile - Carbonitrile - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Carbonyl group - Cyanide - Organopnictogen compound - Organic oxygen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid (or a derivative thereof) which bears an acyl group at its terminal nitrogen atom.

External Descriptors

Not available

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